5,8-dimethylquinoxaline-6,7-diimine

C10H10N4 — CID 59017735

IUPAC5,8-dimethylquinoxaline-6,7-diimine
SMILES[H]/N=C1/C(C)=c2nccnc2=C(C)/C1=N\[H]
InChIInChI=1S/C10H10N4/c1-5-7(11)8(12)6(2)10-9(5)13-3-4-14-10/h3-4,11-12H,1-2H3/b11-7-,12-8+
InChIKeyYYMRMBFXTGEHJM-NTLHZVPKSA-N
MW186.22 g/mol
LogP-0.13
Rot. Bonds

About 5,8-dimethylquinoxaline-6,7-diimine

5,8-dimethylquinoxaline-6,7-diimine (PubChem CID 59017735) has the molecular formula C10H10N4 and a molecular weight of 186.22 g/mol. Its IUPAC name is 5,8-dimethylquinoxaline-6,7-diimine.

Molecular Properties

Compound Name5,8-dimethylquinoxaline-6,7-diimine
PubChem CID59017735
Molecular FormulaC10H10N4
Molecular Weight186.22 g/mol
Exact Mass186.09
IUPAC Name5,8-dimethylquinoxaline-6,7-diimine
SMILES[H]/N=C1/C(C)=c2nccnc2=C(C)/C1=N\[H]
InChIInChI=1S/C10H10N4/c1-5-7(11)8(12)6(2)10-9(5)13-3-4-14-10/h3-4,11-12H,1-2H3/b11-7-,12-8+
InChIKeyYYMRMBFXTGEHJM-NTLHZVPKSA-N
XLogP-0.13
TPSA73.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.22
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(7-Azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium
CID 59017734
6-N,7-N,5,8-tetramethylquinoxaline-6,7-diimine
CID 59207613
4,9-dimethyl-2H-imidazo[4,5-g]quinoxaline
CID 60012342
5,8-Dimethyl-2,3-dihydroquinoxaline-6,7-diamine
CID 123634298
6-N,2,3,5-tetramethyl-8-[(E)-prop-1-enyl]quinoxaline-6,7-diimine
CID 163660469
2,8-Dimethyl-6,7-dihydroquinoxaline
CID 163865948
4,9-Dimethylimidazo[4,5-g]quinoxalin-3-ium
CID 164118880
4,6,7,9-tetramethyl-2H-imidazo[4,5-g]quinoxaline
CID 169800521
5-Methylquinoxaline-6,7-diimine
CID 57641800

Frequently Asked Questions

What is the IUPAC name of 5,8-dimethylquinoxaline-6,7-diimine?
The IUPAC name of 5,8-dimethylquinoxaline-6,7-diimine (CID 59017735) is 5,8-dimethylquinoxaline-6,7-diimine.
What is the SMILES notation for 5,8-dimethylquinoxaline-6,7-diimine?
The canonical SMILES for 5,8-dimethylquinoxaline-6,7-diimine is [H]/N=C1/C(C)=c2nccnc2=C(C)/C1=N\[H].
What is the InChIKey of 5,8-dimethylquinoxaline-6,7-diimine?
The InChIKey is YYMRMBFXTGEHJM-NTLHZVPKSA-N. The full InChI is InChI=1S/C10H10N4/c1-5-7(11)8(12)6(2)10-9(5)13-3-4-14-10/h3-4,11-12H,1-2H3/b11-7-,12-8+.
What are the key properties of 5,8-dimethylquinoxaline-6,7-diimine?
5,8-dimethylquinoxaline-6,7-diimine has a molecular weight of 186.22 g/mol, XLogP of -0.13, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dimethylquinoxaline-6,7-diimine is sourced from PubChem (CID 59017735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).